Title of article
Molecular orbital models of poly(p-phenylene)
Author/Authors
Daly، نويسنده , , H. and Barford، نويسنده , , W. and Bursill، نويسنده , , R.J.، نويسنده ,
Issue Information
دوماهنامه با شماره پیاپی سال 1999
Pages
2
From page
381
To page
382
Abstract
A two molecular orbital model of poly(para-phenylene) based on the under-lying Pariser-Parr-Pople model is introduced. The model is solved using the density matrix renormalisation group method for oligomers of up to 15 repeat units.
Keywords
semi-empirical models and calculations , poly(para-phenylene) and derivatives
Journal title
Synthetic Metals
Serial Year
1999
Journal title
Synthetic Metals
Record number
2072191
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